Picolinium, 4-isopropylthio-, iodide
TL;DR: Picolinium, 4-isopropylthio-, iodide (CAS 101976-25-4) is a chemical compound with molecular formula C9H14INS and molecular weight 294.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-4-propan-2-ylsulfanylpyridin-1-ium iodide
Also Known As: 4-Isopropylthiopicolinium iodide, Pan-W-47, Picolinium, 4-isopropylthio-, iodide, Pyridinium, 4-isopropylthio-1-methyl-, iodide, 1-methyl-4-propan-2-ylsulfanylpyridin-1-ium iodide
| Molecular Formula | C9H14INS |
|---|---|
| Molecular Weight | 294.99 g/mol |
| LogP | -0.9844 |
| Topological Polar Surface Area | 3.88 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 294.98917 |
| Heavy Atoms | 12 |
| Complexity | 220.47507 |
Chemical Identifiers
| CAS Number | 101976-25-4 |
|---|---|
| SMILES | CC(C)SC1=CC=[N+](C=C1)C.[I-] |
Product Overview
Picolinium, 4-isopropylthio-, iodide (CAS 101976-25-4), with molecular formula C9H14INS and molecular weight 294.99 g/mol. IUPAC: 1-methyl-4-propan-2-ylsulfanylpyridin-1-ium iodide.
Chemical Property Profile of Picolinium, 4-isopropylthio-, iodide
Property Insights of Picolinium, 4-isopropylthio-, iodide
The XLogP value of -0.9844 indicates that Picolinium, 4-isopropylthio-, iodide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 3.88 Ų, Picolinium, 4-isopropylthio-, iodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Picolinium, 4-isopropylthio-, iodide has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Picolinium, 4-isopropylthio-, iodide?
The CAS number of Picolinium, 4-isopropylthio-, iodide is 101976-25-4.
What is the molecular formula of Picolinium, 4-isopropylthio-, iodide?
The molecular formula of Picolinium, 4-isopropylthio-, iodide is C9H14INS.
What is the molecular weight of Picolinium, 4-isopropylthio-, iodide?
The molecular weight of Picolinium, 4-isopropylthio-, iodide is 294.99 g/mol.
Where can I buy Picolinium, 4-isopropylthio-, iodide?
You can request a quote for Picolinium, 4-isopropylthio-, iodide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Picolinium, 4-isopropylthio-, iodide?
Yes, KEHONG BIO provides custom synthesis services for Picolinium, 4-isopropylthio-, iodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.